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Phosphoric acid tributylester
ScientificNameLabel
Phosphoric acid tributylester
PHCD compound ID :
4289
Chemical Names :
Phosphoric acid tributylester
Molecular Formula :
C12H27O3P1
Molecular Weight :
250.169781
More Details :
Names & Synonyms:
tributyl phosphite , phosphorous acid tributyl ester
Smiles:
CCCCOP(OCCCC)OCCCC
InChi :
InChI=1S/C12H27O3P/c1-4-7-10-13-16(14-11-8-5-2)15-12-9-6-3/h4-12H2,1-3H3
InChi Key :
InChIKey=XTTGYFREQJCEML-UHFFFAOYSA-N
PubChem ID :
7623
Rotatable bond count :
12
Rule of five :
1
Hydrogen bond acceptor count :
3
Ionization potential :
9.573206
Hydrogen bond donor count :
0
Electric dipole moment :
5.206
XLogP :
3.759
VDW volume :
262.306208
Molecular weight :
250.169781
HOMO-LUMO gap :
9.029000
Herb list :
Nettle, Stinging nettle - Urtica dioica - گزنه دو پایه، گزنه
Refrences & Litretures:
619. Journal:'Iranian Journal of Plant Physiology' Year:'2012' Volume:'2' Page:'339' DOI:'' Title:'Investigating the chemical composition of different parts extracts of bipod nettle Urtica dioica L. in Tonekabon region'
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